A machine learning model for screening thermodynamic stable lead-free halide double perovskites
Gui-Qin Liang, Jian Zhang
Topics & Concepts
HalideStability (learning theory)Perovskite (structure)Chemical stabilityConvex hullDensity functional theoryPeriodic tableComputer scienceMaterials scienceChemistryThermodynamicsAlgorithmApplied mathematicsMachine learningRegular polygonMathematicsComputational chemistryPhysicsInorganic chemistryGeometryCrystallographyOrganic chemistryMachine Learning in Materials SciencePerovskite Materials and ApplicationsAdvanced Thermoelectric Materials and Devices